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91260-06-9 | 4-thiazolidinone, 3-(1,3,4-thiadiazol-2-yl)-2-(2-thienyl)-
CAS No: 91260-06-9 Catalog No: AG006PEK MDL No:
Product Description
Catalog Number:
AG006PEK
Chemical Name:
4-thiazolidinone, 3-(1,3,4-thiadiazol-2-yl)-2-(2-thienyl)-
CAS Number:
91260-06-9
Molecular Formula:
C9H7N3OS3
Molecular Weight:
269.3664
IUPAC Name:
3-(1,3,4-thiadiazol-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C9H7N3OS3/c13-7-4-15-8(6-2-1-3-14-6)12(7)9-11-10-5-16-9/h1-3,5,8H,4H2
InChI Key:
VJQWGBKGIIEMJV-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1c1scnn1)c1cccs1
UNII:
4811RSE6O5
NSC Number:
366086
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.975g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.355g/mol
Monoisotopic Mass:
268.975g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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